[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 4-[(aminocarbonylamino)methyl]benzoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 4-[(aminocarbonylamino)methyl]benzoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 4-(ureidomethyl)benzoate CAS Name: 4-[(carbamoylamino)methyl]benzoic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 4-[(carbamoylamino)methyl]benzoate Traditional Name: 4-(ureidomethyl)benzoic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C16H23N3O4 MolecularWeight: 321.37152

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)COC(=O)C1=CC=C(C=C1)CNC(=O)N

Isomeric SMILES

CCC(CC)NC(=O)COC(=O)C1=CC=C(C=C1)CNC(=O)N

InChI

InChI=1S/C16H23N3O4/c1-3-13(4-2)19-14(20)10-23-15(21)12-7-5-11(6-8-12)9-18-16(17)22/h5-8,13H,3-4,9-10H2,1-2H3,(H,19,20)(H3,17,18,22)